BDBM495401 PET-UNK-29afea89-2::PET-UNK-bcc8fd08-1

SMILES CO[C@]1(CCOc2ccc(Cl)cc12)C(=O)Nc1cncc2ccccc12

InChI Key InChIKey=FRAUGLSYTUOOAF-FQEVSTJZSA-N

Data  6 IC50

PDB links: 3 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 495401   

TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM495401(PET-UNK-29afea89-2 | PET-UNK-bcc8fd08-1)
Affinity DataIC50:  174nMAssay Description:The assay was performed according to the published procedure. Briefly, compounds were seeded into assay-ready plates (Greiner 384PP, cat# 781280) usi...More data for this Ligand-Target Pair
In DepthDetails PDB3D3D Structure (crystal)
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM495401(PET-UNK-29afea89-2 | PET-UNK-bcc8fd08-1)
Affinity DataIC50:  84nMAssay Description:Compounds were seeded into assay-ready plates (Greiner 384 low volume, cat 784900) using an Echo 555 acoustic dispenser, and DMSO was back-filled for...More data for this Ligand-Target Pair
In DepthDetails PDB3D3D Structure (crystal)
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM495401(PET-UNK-29afea89-2 | PET-UNK-bcc8fd08-1)
Affinity DataIC50:  84nMAssay Description:This assay is for S2.More data for this Ligand-Target Pair
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM495401(PET-UNK-29afea89-2 | PET-UNK-bcc8fd08-1)
Affinity DataIC50:  84nMAssay Description:Compounds were seeded into assay-ready plates (Greiner 384 low volume, cat 784900) using an Echo 555 acoustic dispenser, and DMSO was back-filled for...More data for this Ligand-Target Pair
In DepthDetails PDB3D3D Structure (crystal)
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM495401(PET-UNK-29afea89-2 | PET-UNK-bcc8fd08-1)
Affinity DataIC50:  84nMAssay Description:Compounds were seeded into assay-ready plates (Greiner 384 low volume, cat. no. 784900) using an Echo 555 acoustic dispenser, and dimethyl sulfoxide ...More data for this Ligand-Target Pair
TargetReplicase polyprotein 1ab(2019-nCoV)
Israel Institution Of Biological Research

LigandPNGBDBM495401(PET-UNK-29afea89-2 | PET-UNK-bcc8fd08-1)
Affinity DataIC50:  174nMAssay Description:The assay was performed according to the published procedure. Briefly, compounds were seeded into assay-ready plates (Greiner 384PP, cat# 781280) usi...More data for this Ligand-Target Pair
In DepthDetails PDB3D3D Structure (crystal)